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The induced-proximity effects of nearly commensurate lattice structure of a graphene layer on Ni(111) and Co(0001) substrates in the AC stacking configuration are addressed through an analytical tight-binding approach within the…

Mesoscale and Nanoscale Physics · Physics 2019-06-05 Mayra Peralta , Ernesto Medina , Francisco Mireles

We introduce a $p_{z}-d$ coupling model Hamiltonian for the $\pi$-graphene/Au bands that predicts a rather large intrinsic spin-orbit (SO) coupling as are being reported in recent experiments and DFT studies. Working within the analytical…

Materials Science · Physics 2019-10-03 Alejandro Lopez , Luis Colmenarez , Mayra Peralta , Francisco Mireles , Ernesto Medina

Magnetic proximity effects in Co/hBN/graphene heterostructures are systematically analyzed via first-principles calculations, demonstrating a pronounced localized spatial variation of the induced spin polarization of graphene's Dirac…

Mesoscale and Nanoscale Physics · Physics 2026-01-13 Klaus Zollner , Lukas Cvitkovich , Riccardo Silvioli , Andreas V. Stier , Jaroslav Fabian

We perform systematic first-principles calculations of the proximity exchange coupling, induced by cobalt (Co) and nickel (Ni) in graphene, via a few (up to three) layers of hexagonal boron nitride (hBN). We find that the induced spin…

Mesoscale and Nanoscale Physics · Physics 2016-10-26 Klaus Zollner , Martin Gmitra , Tobias Frank , Jaroslav Fabian

The electronic properties of graphene decorated with Ni, Co, Cu and Zn adatoms is studied with the density functional theory approach. Within the analysis the spin-orbit interaction is taken into account. We focus on the case when the…

Applied Physics · Physics 2019-03-01 Malgorzata Wawrzyniak-Adamczewska

We study orbital and spin-orbit proximity effects in graphene adsorbed to the Cu(111) surface by means of density functional theory (DFT). The proximity effects are caused mainly by the hybridization of graphene $\pi$ and copper d orbitals.…

Mesoscale and Nanoscale Physics · Physics 2016-04-27 Tobias Frank , Martin Gmitra , Jaroslav Fabian

We present a combined DFT and model Hamiltonian analysis of spin-orbit coupling in graphene induced by copper adatoms in the bridge and top positions, representing isolated atoms in the dilute limit. The orbital physics in both systems is…

Mesoscale and Nanoscale Physics · Physics 2017-01-11 Tobias Frank , Susanne Irmer , Martin Gmitra , Denis Kochan , Jaroslav Fabian

Carbon-based magnetic structures promise significantly longer coherence times than traditional magnetic materials, which is of fundamental importance for spintronic applications. An elegant way of achieving carbon-based magnetic moments is…

Mesoscale and Nanoscale Physics · Physics 2023-07-19 Qiang Sun , Xuelin Yao , Oliver Groning , Kristjan Eimre , Carlo A. Pignedoli , Klaus Müllen , Akimitsu Narita , Roman Fasel , Pascal Ruffieux

The physical origin of the mechanism of the formation of ferromagnetic ordering in carbon nanotubes (NTs), produced by high energy ion beam modification of diamond single crystals in $\langle{110}\rangle$ and $\langle{111}\rangle$…

Strongly Correlated Electrons · Physics 2015-03-19 Dmitri Yerchuck , Vyacheslav Stelmakh , Alla Dovlatova , Yauhen Yerchak , Andrey Alexandrov

We discuss the properties of possible ferromagnetic orders on the Lieb lattice. We show that the presence of a quadratic-flat band crossing point (QFBCP) at half filling will dramatically affect the magnetic ordering. In the presence of a…

Quantum Gases · Physics 2014-10-07 Ke-Ji Chen , Wei Zhang

The so-called spin-orbit proximity effect experimentally realized in graphene (G) on several different heavy metal surfaces opens a new perspective to engineer the spin-orbit coupling (SOC) for new generation spintronics devices. Here, via…

Materials Science · Physics 2019-07-10 Jagoda Slawinska , Jorge I. Cerdá

Using first-principles calculations we demonstrate sizable exchange coupling between a magnetic molecule and a magnetic substrate via a graphene layer. As a model system we consider cobaltocene (CoCp$_2$) adsorbed on graphene deposited on…

Mesoscale and Nanoscale Physics · Physics 2015-06-15 Simone Marocchi , Paolo Ferriani , Nuala Mai Caffrey , Franca Manghi , Stefan Heinze , Valerio Bellini

The proximity-induced couplings in graphene due to the vicinity of a ferromagnetic insulator are analyzed. We combine general symmetry principles and simple tight-binding descriptions to consider different orientations of the magnetization.…

Mesoscale and Nanoscale Physics · Physics 2019-10-15 Vo Tien Phong , Niels R. Walet , Francisco Guinea

Ordered configurations of hydrogen adatoms on graphene have long been proposed, calculated and searched for. Here we report direct observation of several ordered configurations of H adatoms on graphene by scanning tunneling microscopy. On…

We study the properties of flat-bands that appear in a heterostructure composed of strands of different widths of graphene armchair nanoribbons. One of the flat-bands is reminiscent of the one that appears in pristine armchair nanoribbons…

Mesoscale and Nanoscale Physics · Physics 2022-02-18 P. A. Almeida , L. S. Sousa , Tome M. Schmidt , G. B. Martins

We reveal that the origin of ferromagnetism caused by $sp$ electrons in graphene with vacancies can be traced to electrons partially filling $sp^{2*}$-antibonding and $p_z^*$-nonbonding states, which are induced by the vacancies and appear…

Materials Science · Physics 2019-01-30 Wei Xu , J. G. Che

We present a theoretical study of the optical conductivity of graphene with magnetic and nonmagnetic adatoms. First, by introducing alternating potential in a pure graphene, we demonstrate a gap formation in the density of states and the…

Strongly Correlated Electrons · Physics 2015-01-13 Muhammad Aziz Majidi , Syahril Siregar , Andrivo Rusydi

This study theoretically investigated the magnetic properties and electronic structure of a graphene-based nano-spin-valve-like structure. Magnetic nickel layers on both sides of the graphene were considered. A spin-polarized…

Mesoscale and Nanoscale Physics · Physics 2019-05-30 Yusuf Wicaksono , Shingo Teranishi , Kazutaka Nishiguchi , Koichi Kusakabe

Hydrogen adatoms are one of the most the promising proposals for the functionalization of graphene. Hydrogen induces narrow resonances near the Dirac energy, which lead to the formation of magnetic moments. Furthermore, they also create…

Mesoscale and Nanoscale Physics · Physics 2018-04-24 Luis A. González-Árraga , J. L. Lado , F. Guinea

This work is devoted to the analysis of orbital patterns and related to them interatomic magnetic interactions in centrosymmetric monoclinic structures of BiMnO$_3$, which have been recently determined experimentally. First, we set up an…

Materials Science · Physics 2008-07-11 I. V. Solovyev , Z. V. Pchelkina
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